ethyl 2-tert-butyl-5-[[2-(trifluoromethyl)phenyl]methoxy]-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 2-tert-butyl-5-[[2-(trifluoromethyl)phenyl]methoxy]-1-benzofuran-3-carboxylate Openeye Name: ethyl 2-tert-butyl-5-[[2-(trifluoromethyl)phenyl]methoxy]benzofuran-3-carboxylate CAS Name: 2-tert-butyl-5-[[2-(trifluoromethyl)phenyl]methoxy]-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-tert-butyl-5-[[2-(trifluoromethyl)phenyl]methoxy]-1-benzofuran-3-carboxylate Traditional Name: 2-tert-butyl-5-[2-(trifluoromethyl)benzyl]oxy-benzofuran-3-carboxylic acid ethyl ester Formula: C23H23F3O4 MolecularWeight: 420.42153

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC3=CC=CC=C3C(F)(F)F)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C=C(C=C2)OCC3=CC=CC=C3C(F)(F)F)C(C)(C)C

InChI

InChI=1S/C23H23F3O4/c1-5-28-21(27)19-16-12-15(10-11-18(16)30-20(19)22(2,3)4)29-13-14-8-6-7-9-17(14)23(24,25)26/h6-12H,5,13H2,1-4H3